2-amino-4-(5-tert-butylthiophen-2-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-7428 |
| Compound Name: | 2-amino-4-(5-tert-butylthiophen-2-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 452.02 |
| Molecular Formula: | C25 H26 Cl N3 O S |
| Smiles: | Cc1c(cccc1[Cl])N1C2CCCC(C=2C(C(C#N)=C1N)c1ccc(C(C)(C)C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7657 |
| logD: | 5.7657 |
| logSw: | -5.7731 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.094 |
| InChI Key: | OFJVPBUKNPEUOT-JOCHJYFZSA-N |